Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.39 |
| ▸ | PTGES | O14684 | 2/20 | 0.37 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.37 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.37 |
| ▸ | PRKACA | P17612 | 1/20 | 0.37 |
| ▸ | PRKACG | P22612 | 1/20 | 0.37 |
| ▸ | PRKACB | P22694 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | CAMK2B | Q13554 | 1/20 | 0.37 |
| ▸ | CAMK2G | Q13555 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL311307 | 1.00 | ALDH1A1 (0.50) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| SCHEMBL21764658 | 1.00 | ALDH1A1 (0.50) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| SCHEMBL2906916 | 0.97 | ALDH1A1 (0.46) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| SCHEMBL30608977 | 0.88 | PARP1 (0.39) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| SCHEMBL29275133 | 0.88 | PARP1 (0.39) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| SCHEMBL19164356 | 0.86 | ALDH1A1 (0.39) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| SCHEMBL19164105 | 0.85 | PARP1 (0.41) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| SCHEMBL17381206 | 0.84 | ALDH1A1 (0.45) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| SCHEMBL29650352 | 0.83 | PTGES (0.39) | ALDH1A1CYP1A2HPGDHSD17B10THRB | |
| SCHEMBL28650295 | 0.83 | PTGES (0.39) | ALDH1A1CYP1A2HPGDHSD17B10THRB |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118684697-A | Organic compound, light-emitting device including the same, electronic apparatus, and electronic device | 三星显示有限公司 | 2024-09-24 | — | — | CN | disclosed |